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SMILES: C1N(Cc2c(C1)ncnc2Cl)C(=O)OC(C)(C)C Canonical SMILES: O=C(N1CCc2c(C1)c(Cl)ncn2)OC(C)(C)C InChI: InChI=1S/C12H16ClN3O2/c1-12(2,3)18-11(17)16-5-4-9-8(6-16)10(13)15-7-14-9/h7H,4-6H2,1-3H3 InChIKey: YSSUXXNMVJXCBS-UHFFFAOYSA-N
CBID:65210 http://www.chembase.cn/molecule-65210.html